Bromobenzene

Bromobenzene

SCHEMBL27771837

Brc1ccccc1.CCOC(C)=O

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.56
▸ LMNA P02545 2/20 0.56
▸ HSD17B10 Q99714 1/20 0.56
▸ TSHR P16473 1/20 0.48
▸ MEN1 O00255 3/20 0.46
▸ KMT2A Q03164 3/20 0.46
▸ MAPT P10636 2/20 0.46
▸ S1PR4 O95977 1/20 0.46
▸ S1PR1 P21453 1/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.46
▸ MMP8 P22894 2/20 0.45
▸ PIN1 Q13526 2/20 0.44
▸ GAA P10253 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ CYP19A1 P11511 1/20 0.44
▸ NPC1 O15118 2/20 0.43
▸ HPGD P15428 1/20 0.42
▸ RAB9A P51151 1/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Bromobenzene SCHEMBL27762786 0.91 ALDH1A1 (0.47) ALDH1A1LMNAHSD17B10TSHRMEN1
Ethyl Acetate SCHEMBL27610052 0.90 ALDH1A1 (0.64) ALDH1A1LMNAHSD17B10TSHRMEN1
Ethyl Acetate SCHEMBL27610053 0.86 ALDH1A1 (0.58) ALDH1A1LMNAHSD17B10TSHRMEN1
Ethyl Pyruvate SCHEMBL27571547 0.85 MAPT (0.51) ALDH1A1LMNATSHRMEN1KMT2A
Toluene SCHEMBL1498823 0.83 ALDH1A1 (0.61) ALDH1A1LMNAHSD17B10TSHRMEN1
Toluene SCHEMBL1159815 0.83 ALDH1A1 (0.61) ALDH1A1LMNAHSD17B10TSHRMEN1
Toluene SCHEMBL856707 0.83 ALDH1A1 (0.61) ALDH1A1LMNAHSD17B10TSHRMEN1
Toluene SCHEMBL510300 0.83 ALDH1A1 (0.61) ALDH1A1LMNAHSD17B10TSHRMEN1
Toluene SCHEMBL21490912 0.83 ALDH1A1 (0.61) ALDH1A1LMNAHSD17B10TSHRMEN1
Toluene SCHEMBL1077296 0.83 ALDH1A1 (0.61) ALDH1A1LMNAHSD17B10TSHRMEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111763455-B Preparation method of heat-insulating high-shading paint 江苏大亚新型包装材料有限公司 2022-02-22 — — CN claimed
CN-111763455-A Preparation method of heat-insulating high-shading paint 江苏大亚新型包装材料有限公司 2020-10-13 — — CN claimed
CN-101659719-B Room-temperature self-repairing type thermoplastic polymer material and preparation method thereof UNIV SUN YAT SEN 2011-03-30 — — CN claimed
CN-101659719-A Room-temperature self-repairing type thermoplastic polymer material and preparation method thereof UNIV SUN YAT SEN 2010-03-03 — — CN claimed
CN-111763455-B Preparation method of heat-insulating high-shading paint 江苏大亚新型包装材料有限公司 2022-02-22 — — CN disclosed
CN-111040060-B Method for polymerizing 'active' free radical of vinyl monomer under near-infrared photo-thermal conversion 苏州大学 2020-12-29 — — CN disclosed
CN-111763455-A Preparation method of heat-insulating high-shading paint 江苏大亚新型包装材料有限公司 2020-10-13 — — CN disclosed
CN-111040060-A Method for polymerizing 'active' free radical of vinyl monomer under near-infrared photo-thermal conversion 苏州大学 2020-04-21 — — CN disclosed
CN-105646306-A Preparation method of 4-methylthio phenylacetic acid 惠州市莱佛士制药技术有限公司 2016-06-08 — — CN disclosed
CN-101463031-B Indazole and tetrahydrochysene indazole compounds, and preparation, pharmaceutical composition and use thereof INST MATERIA MEDICA CAMS 2014-02-12 — — CN disclosed
CN-101659719-B Room-temperature self-repairing type thermoplastic polymer material and preparation method thereof UNIV SUN YAT SEN 2011-03-30 — — CN disclosed
CN-101659719-A Room-temperature self-repairing type thermoplastic polymer material and preparation method thereof UNIV SUN YAT SEN 2010-03-03 — — CN disclosed
CN-101463031-A Indazole and tetrahydrochysene indazole compounds, and preparation, pharmaceutical composition and use thereof INST MATERIA MEDICA CAMS (CN) 2009-06-24 — — CN disclosed
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